N-[bis(azanyl)methylidene]-2-methyl-5-methylsulfonyl-4-phenoxy-benzamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-2-methyl-5-methylsulfonyl-4-phenoxy-benzamide hydrochloride Openeye Name: N-(diaminomethylene)-2-methyl-5-methylsulfonyl-4-phenoxy-benzamide hydrochloride CAS Name: N-(diaminomethylidene)-2-methyl-5-methylsulfonyl-4-phenoxybenzamide hydrochloride IUPAC Name: N-(diaminomethylidene)-2-methyl-5-methylsulfonyl-4-phenoxybenzamide hydrochloride Traditional Name: N-(diaminomethylene)-5-mesyl-2-methyl-4-phenoxy-benzamide hydrochloride Formula: C16H18ClN3O4S MolecularWeight: 383.84982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)OC2=CC=CC=C2.Cl

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)OC2=CC=CC=C2.Cl

InChI

InChI=1S/C16H17N3O4S.ClH/c1-10-8-13(23-11-6-4-3-5-7-11)14(24(2,21)22)9-12(10)15(20)19-16(17)18;/h3-9H,1-2H3,(H4,17,18,19,20);1H